1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine

C8H16N6 — CID 82647669

IUPAC1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine
SMILESCc1nnn(CCN2CCNCC2)n1
InChIInChI=1S/C8H16N6/c1-8-10-12-14(11-8)7-6-13-4-2-9-3-5-13/h9H,2-7H2,1H3
InChIKeyCZQUWXBHYRHQIA-UHFFFAOYSA-N
MW196.26 g/mol
LogP-1.11
Rot. Bonds3

About 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine

1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine (PubChem CID 82647669) has the molecular formula C8H16N6 and a molecular weight of 196.26 g/mol. Its IUPAC name is 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine.

Molecular Properties

Compound Name1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine
PubChem CID82647669
Molecular FormulaC8H16N6
Molecular Weight196.26 g/mol
Exact Mass196.14
IUPAC Name1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine
SMILESCc1nnn(CCN2CCNCC2)n1
InChIInChI=1S/C8H16N6/c1-8-10-12-14(11-8)7-6-13-4-2-9-3-5-13/h9H,2-7H2,1H3
InChIKeyCZQUWXBHYRHQIA-UHFFFAOYSA-N
XLogP-1.11
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.26
LogP ≤ 5-1.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine?
The IUPAC name of 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine (CID 82647669) is 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine.
What is the SMILES notation for 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine?
The canonical SMILES for 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine is Cc1nnn(CCN2CCNCC2)n1.
What is the InChIKey of 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine?
The InChIKey is CZQUWXBHYRHQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N6/c1-8-10-12-14(11-8)7-6-13-4-2-9-3-5-13/h9H,2-7H2,1H3.
What are the key properties of 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine?
1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine has a molecular weight of 196.26 g/mol, XLogP of -1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-methyltetrazol-2-yl)ethyl]piperazine is sourced from PubChem (CID 82647669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).